Vitas-M small molecule compound
6,6-dimethyl-9-(4-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK217339
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)[N+](=O)[O-])n1c(N2)ncn1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H17N5O3 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3/c1-17(2)7-12-14(13(23)8-17)15(21-16(20-12)18-9-19-21)10-3-5-11(6-4-10)22(24)25/h3-6,9,15H,7-8H2,1-2H3,(H,18,19,20)InChIKey
VDAMFCTXJJFANM-UHFFFAOYSA-NSynonyms
421586-25-6421586256
66dimethyl9(4nitrophenyl)1579tetrahydro(124)triazolo(51b)quinazolin8one
66dimethyl9(4nitrophenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
CC1(CC2=C(C(N3C(=N2)N=CN3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C1)C
InChI=1SC17H17N5O3c117(2)71214(13(23)817)15(2116(2012)1891921)103511(6410)22(24)25h36915H78H212H3(H181920)
MFCD02934068
O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)(N+)(=O)(O))n1c(N2)ncn1
ZINC000018219343
ZINC000018219344
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